SCHEMBL2994781

SCHEMBL2994781

CCCCCCCCCCCS[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.58
▸ LGALS1 P09382 2/20 0.58
▸ LGALS9 O00182 1/20 0.53
▸ LGALS8 O00214 1/20 0.53
▸ MAPK1 P28482 1/20 0.39
▸ GBA1 P04062 1/20 0.39
▸ GAA P10253 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12613061 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL1665970 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL416020 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL7131119 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL2989790 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL2254301 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL4314813 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL1666527 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL151041 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1
SCHEMBL9350382 1.00 LGALS3 (0.58) LGALS3LGALS1LGALS9LGALS8MAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100172845-A1 COMPOSITIONS AND METHODS FOR TREATING MYCOBACTERIAL INFECTIONS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-07-08 — — US claimed
WO-2009002652-A9 USE OF SURFACTANTS FOR TREATING MYCOBACTERIAL INFECTIONS UNIV TEXAS (US) 2009-02-12 — — WO claimed
WO-2009002652-A2 USE OF SURFACTANTS FOR TREATING MYCOBACTERIAL INFECTIONS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-12-31 — — WO claimed
US-20080269163-A1 Methods and Compositions for Protecting Cells from Ultrasound-Mediated Cytolysis UNIVERSITY OF FUKUI (JP) 2008-10-30 — — US claimed
US-20100172845-A1 COMPOSITIONS AND METHODS FOR TREATING MYCOBACTERIAL INFECTIONS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-07-08 — — US disclosed
WO-2009002652-A9 USE OF SURFACTANTS FOR TREATING MYCOBACTERIAL INFECTIONS UNIV TEXAS (US) 2009-02-12 — — WO disclosed
WO-2009002652-A2 USE OF SURFACTANTS FOR TREATING MYCOBACTERIAL INFECTIONS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-12-31 — — WO disclosed
US-20080269163-A1 Methods and Compositions for Protecting Cells from Ultrasound-Mediated Cytolysis UNIVERSITY OF FUKUI (JP) 2008-10-30 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269163-A1 Methods and Compositions for Protecting Cells from Ultrasound-Mediated Cytolysis GZMB, RNASE1, CASP3 LGALS3 80/4885LGALS1 98/4885LGALS9 173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback